CNDO/II treatment of proton abstraction step in aromatic lithiation reaction |
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| Authors: | B H Bhide V G Prabhu and Arabinda Ray |
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| Institution: | (1) Department of Chemistry, Sardar Patel University, 388 120 Vallabh Vidyanagar, India |
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| Abstract: | All valence MO calculation employing CNDO/II treatment for hydrogen abstraction step in aromatic ortho lithiation reaction
is done. The predicted proton abstraction is supported by experimental observation. The lithiation of N-methyl-β-naphthamide occurs at the 1 position and not at the 3 position. |
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| Keywords: | CNDO/II calculation charge ono-hydrogen |
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